Isopropyl isothiocyanate

Isopropyl isothiocyanate
  • CAS No.:2253-73-8
Other grades of this product :
Isopropyl isothiocyanate Basic information
Product Name:Isopropyl isothiocyanate
Synonyms:2-ISOTHIOCYANATO-PROPANE;IPNCS;ISOPROPYL ISOTHIOCYANATE;ISOTHIOCYANIC ACID ISOPROPYL ESTER;Propane, 2-isothiocyanato-;Isopropyl isothiocyanate, 95+%;Isothiocyanato-2-propane;Isopropyl isothiocya
CAS:2253-73-8
MF:C4H7NS
MW:101.17
EINECS:218-851-3
Product Categories:Aliphatics
Mol File:2253-73-8.mol
Isopropyl isothiocyanate Chemical Properties
Melting point 168-170 °C
Boiling point 29-30 °C/10 mmHg (lit.)
density 0.948 g/mL at 25 °C (lit.)
refractive index n20/D 1.493(lit.)
FEMA 4425 | ISOPROPYL ISOTHIOCYANATE
Fp 104 °F
storage temp. Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
form clear liquid
color Colorless to Light orange to Yellow
Specific Gravity0.95
Water Solubility Miscible with methanol. Hydrolyzes in water.
Sensitive Moisture Sensitive
JECFA Number1888
BRN 1739163
CAS DataBase Reference2253-73-8(CAS DataBase Reference)
NIST Chemistry ReferenceIsopropyl isothiocyanate(2253-73-8)
Safety Information
Hazard Codes Xi,T
Risk Statements 10-36/37/38-23/24/25
Safety Statements 16-26-36-45-38-36/37/39-28A
RIDADR UN 1993 3/PG 3
WGK Germany 3
HazardClass 8
PackingGroup III
HS Code 29309090
MSDS Information
ProviderLanguage
Isopropyl isothiocyanate English
SigmaAldrich English
ALFA English
Isopropyl isothiocyanate Usage And Synthesis
Chemical PropertiesColorless liquid
Chemical PropertiesColorless liquid; penetrating, mustard-like aroma.
OccurrenceReported found in Brussel sprouts, Chinese cabbage, Japanese horseradish, and wasabi.
UsesIsopropyl isothiocyanate is used as is an antimicrobial agent. It is also used as medicinal intermediate.
UsesIsopropyl isothiocyanate may be used to synthesize 4-bromo-5,6-dichloro-2-isopropylaminobenzimidazole.
Aroma threshold valuesHigh strength odor, recommend smelling in a 0.01% solution or less.
General DescriptionIsopropyl isothiocyanate is an isothiocyanate derivative. It has been identified as one of the volatile components in the following:
  • seed kernel and leaf of Moringa peregrina (Forssk.) Fiori, Agricolt1
  • essential oil isolated from Upland Wasabi
  • hydrodistillates of hedge mustard (Sysimbrium officinale)
Molecular conformations of isopropyl isothiocyanate in gas phase have been determined by electron diffraction studies. It has been synthesized by employing isopropyl amine as a starting reagent.
Isopropyl isothiocyanate Preparation Products And Raw materials
Preparation Products4-ISOPROPYL-3-THIOSEMICARBAZIDE

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